NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2874 8.2649 123.5786 52.0990 19.9487 176.7979 2 C 4.5631 8.3418 117.1016 55.6560 41.4704 172.6659 3 D 4.2249 9.4401 125.0646 56.6034 42.3697 176.3643 4 Y 4.7844 7.7966 115.4667 56.4670 42.5340 174.4151 5 T 4.8468 8.7094 120.5156 62.2755 71.4922 174.1580 6 C 4.7267 9.3166 126.3333 55.6180 41.6496 176.8003 7 G 3.8279 8.6902 119.0546 46.7133 0.0000 173.3822 8 S 4.5975 9.0866 118.3822 57.7411 64.4111 173.9992 9 N 4.3338 8.2943 120.8767 53.0449 38.9671 172.7416 10 C 4.9611 8.1762 122.7561 55.0056 46.6894 172.3108 11 Y 5.4082 8.8885 123.4536 56.3392 41.9422 175.1101 12 S 5.1440 9.8012 117.6681 56.9010 65.8137 175.3699 13 S 4.4034 9.3195 117.0226 61.8036 62.4129 177.3445 14 S 4.1677 8.0917 116.6396 61.3896 62.8359 176.1565 15 D 4.3897 8.0215 122.1239 57.0887 40.5308 178.6025 16 A 3.8341 7.9569 120.7935 55.3574 18.4346 179.8901 17 S 4.0558 8.2719 113.7592 61.9088 62.7317 177.2445 18 T 3.8511 8.0636 118.2646 66.5058 68.1831 176.6948 19 A 4.1766 7.9744 122.7244 55.2519 18.4320 179.3692 20 Q 3.7002 8.4355 118.2578 59.2492 29.2066 178.3401 21 A 3.8252 7.9741 121.4599 54.9998 18.4669 179.5659 22 A 3.7928 7.6805 118.9425 55.1793 18.5490 180.0768 23 G 2.2799 7.0044 104.2607 47.5782 0.0000 175.2587 24 Y 3.5499 7.5019 122.3188 59.8510 38.7013 177.9411 25 K 3.7102 7.5880 120.1660 59.4446 32.3040 178.8203 26 L 3.8857 7.4094 118.9244 57.7947 41.5797 178.9449 27 H 3.9608 7.8926 118.1476 59.4059 29.5839 177.2616 28 E 3.6505 7.7151 119.1652 58.9520 29.2992 178.2724 29 D 4.5658 7.7598 116.4830 53.6643 41.2468 176.7090 30 G 3.8169 7.5432 107.0344 46.5971 0.0000 173.2819 31 E 4.9833 8.0798 117.8624 54.3928 32.2721 175.6605 32 T 5.2986 8.4125 110.8254 60.2366 72.3934 173.1973 33 V 4.5670 9.3496 121.5221 61.1760 35.4388 176.1575 34 G 4.6961 8.8882 105.2726 47.0762 0.0000 174.8057 35 S 4.2321 8.5658 114.9779 60.7878 62.9893 175.1981 36 N 4.5371 8.1468 115.6200 52.0695 38.8845 175.1367 37 S 3.7198 7.4694 113.7697 59.7540 60.5893 171.1913 38 Y 5.0714 8.4993 119.5432 56.2243 40.1127 174.8228 39 P 5.6794 0.0000 0.0000 63.2982 33.0147 174.5980 40 H 5.2742 8.9012 115.8591 53.4636 32.7681 172.2464 41 K 4.3002 9.0394 120.1949 57.0555 32.7337 175.1079 42 Y 4.6248 8.5337 128.8639 56.0340 39.3804 175.3785 43 N 4.1314 8.2260 124.5856 53.7505 39.7134 174.4033 44 N 3.6346 6.2067 115.7190 54.4457 36.8936 174.8386 45 Y 4.3321 7.1568 116.4801 61.2496 38.6466 178.4161 46 E 3.7795 8.0623 118.3321 57.4178 29.5286 177.0456 47 G 3.6984 7.6460 105.8987 46.3143 0.0000 173.9205 48 F 4.2993 7.7899 117.6333 57.3307 39.3898 176.3544 49 D 4.6145 8.1110 124.7803 53.1261 39.3368 175.9669 50 F 4.7428 7.7158 120.9636 56.9080 40.0342 176.3261 51 S 4.4043 8.7979 117.9653 60.0947 63.5696 174.6918 52 V 4.4320 7.5968 113.7474 59.4116 33.3043 175.6893 53 S 4.4454 8.3641 116.9824 57.8963 63.7840 174.0387 54 S 3.2106 7.8393 116.5464 56.1557 64.2104 171.8198 55 P 4.0638 0.0000 0.0000 62.8635 32.3344 175.3697 56 Y 5.0314 7.8013 118.5362 56.5702 41.6097 174.3240 57 Y 5.1514 8.4115 118.7714 56.1439 42.4402 174.1413 58 E 5.0259 9.2806 121.0789 54.5082 32.9111 174.6765 59 W 5.2463 8.5518 130.6707 55.2136 34.6319 172.3281 60 P 4.3150 0.0000 0.0000 62.3422 31.4993 175.3344 61 I 4.3288 7.6233 123.1913 59.1103 40.1920 174.6189 62 L 4.7574 8.3213 129.0290 52.9233 43.2978 177.7075 63 S 4.4647 8.7766 117.4091 60.5432 63.2429 175.4910 64 S 4.2002 8.0311 115.1882 59.6318 63.1726 175.1944 65 G 4.0512 8.2486 109.4974 45.2400 0.0000 173.5706 66 D 4.6400 7.3741 118.5817 53.7294 41.6312 175.9366 67 V 4.1205 8.0611 120.9586 61.8136 32.5444 175.3717 68 Y 4.1484 8.7674 127.9214 58.3856 38.9088 176.4186 69 S 4.4269 8.1627 118.7098 57.6622 64.3227 172.2519 70 G 3.4399 7.0588 105.9923 44.8116 0.0000 174.4512 71 G 3.7733 8.4088 106.4096 44.4595 0.0000 172.5183 72 S 4.2986 8.5400 114.2647 57.9759 62.7557 173.7477 73 P 3.9276 0.0000 0.0000 63.1392 31.6557 177.4003 74 G 3.7598 7.9664 105.8633 44.7383 0.0000 172.1923 75 A 4.6609 8.3640 117.8568 52.1814 20.6749 176.8745 76 D 5.3473 7.9405 115.3851 52.9857 43.7087 175.7651 77 R 4.7302 8.7306 119.2212 54.8078 35.1925 174.4145 78 V 4.3641 8.6994 115.7178 59.6668 34.4740 174.9698 79 V 4.5705 8.4255 124.6810 60.9128 33.7894 174.4178 80 F 5.4798 8.2448 122.0850 55.2647 42.1256 173.3188 81 N 5.9787 8.7008 116.8033 50.2222 39.9141 174.9183 82 E 4.2752 9.1728 118.3641 59.4378 29.7071 177.2127 83 N 4.6671 8.6130 114.2775 52.4812 38.7698 174.1427 84 N 3.5864 7.9446 115.7347 54.6016 37.7854 173.7233 85 Q 4.5410 7.9867 114.6041 53.6173 31.1293 174.9800 86 L 4.4403 8.3260 123.7115 54.6482 42.8308 176.2043 87 A 4.0279 8.9275 129.8560 53.0125 19.4560 176.8244 88 G 3.8055 6.1896 101.0596 46.3295 0.0000 171.7656 89 V 4.6485 7.3090 119.1086 60.7199 34.0520 174.3757 90 I 4.9901 8.2449 120.3839 59.6050 41.4809 173.8604 91 T 5.2793 8.8835 115.6424 61.5368 70.7477 174.1134 92 H 4.6417 9.2765 122.3788 57.1494 29.3039 176.0926 93 T 4.1050 7.7483 117.3342 64.9965 68.3627 174.6098 94 G 3.9292 9.2056 113.9959 45.2766 0.0000 172.4999 95 A 4.8492 7.6715 121.7857 49.6544 21.7493 176.8934 96 S 4.3282 8.5661 115.9780 59.0764 64.9583 174.6997 97 G 3.6549 8.1511 111.2642 47.6285 0.0000 173.7008 98 N 4.5205 8.6489 121.5399 52.8502 38.3582 174.6036 99 N 4.8701 7.9015 117.4148 53.0764 39.4762 173.7324 100 F 5.4108 8.7922 117.2822 56.1532 42.6685 175.2931 101 V 5.0408 9.0024 112.9870 59.7184 35.9866 175.2181 102 E 4.2339 8.7852 121.7653 56.3815 30.4169 177.0434 103 C 4.8197 8.7310 120.7034 56.3302 41.5169 174.2209 104 T 4.1368 8.2471 112.1066 61.9850 68.5935 174.4691 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.26 4.29 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 8.34 4.56 0.00 3.03 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 D 9.44 4.22 0.00 2.54 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 7.80 4.78 0.00 3.04 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.71 4.85 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 6 C 9.32 4.73 0.00 3.14 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.69 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 9.09 4.60 0.00 3.94 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 8.29 4.33 0.00 2.82 2.27 0.00 0.00 6.39 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 C 8.18 4.96 0.00 2.84 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.89 5.41 0.00 3.10 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 9.80 5.14 0.00 3.88 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 9.32 4.40 0.00 3.91 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.09 4.17 0.00 4.07 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.02 4.39 0.00 3.01 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.96 3.83 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.27 4.06 0.00 3.87 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.06 3.85 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 19 A 7.97 4.18 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.44 3.70 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 21 A 7.97 3.83 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.68 3.79 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 7.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.50 3.55 0.00 2.29 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.59 3.71 0.00 1.77 1.73 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.37 7.81 26 L 7.41 3.89 0.00 1.63 1.85 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 27 H 7.89 3.96 0.00 3.22 3.06 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.72 3.65 0.00 1.80 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.50 0.00 29 D 7.76 4.57 0.00 2.57 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 7.54 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.08 4.98 0.00 1.83 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 32 T 8.41 5.30 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 33 V 9.35 4.57 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.93 0.00 0.00 34 G 8.89 4.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.57 4.23 0.00 3.93 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.15 4.54 0.00 1.95 2.45 0.00 0.00 7.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.47 3.72 0.00 3.95 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.50 5.07 0.00 3.17 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 5.68 0.00 2.36 2.53 0.00 4.10 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.25 0.00 40 H 8.90 5.27 0.00 3.18 3.69 0.00 5.27 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 9.04 4.30 0.00 1.87 1.81 0.00 1.71 0.00 0.00 1.54 0.00 0.00 2.63 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.29 7.81 42 Y 8.53 4.62 0.00 2.80 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 N 8.23 4.13 0.00 1.58 2.53 0.00 0.00 7.11 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 6.21 3.63 0.00 3.15 2.86 0.00 0.00 7.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.16 4.33 0.00 2.97 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.06 3.78 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 47 G 7.65 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 7.79 4.30 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.11 4.61 0.00 2.64 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 7.72 4.74 0.00 3.06 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.80 4.40 0.00 4.04 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.60 4.43 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.06 0.00 0.00 53 S 8.36 4.45 0.00 3.95 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 7.84 3.21 0.00 3.35 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.06 0.00 1.88 1.72 0.00 3.50 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.00 0.00 56 Y 7.80 5.03 0.00 3.12 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 8.41 5.15 0.00 1.66 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 9.28 5.03 0.00 1.76 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 59 W 8.55 5.25 0.00 3.66 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.31 0.00 0.70 1.28 0.00 2.20 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 61 I 7.62 4.33 1.57 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.64 0.33 0.00 0.00 62 L 8.32 4.76 0.00 1.94 1.61 1.07 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.78 4.46 0.00 3.96 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.03 4.20 0.00 4.03 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.25 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.37 4.64 0.00 2.68 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 V 8.06 4.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.02 0.00 0.00 68 Y 8.77 4.15 0.00 2.59 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.16 4.43 0.00 3.88 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 7.06 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.41 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.54 4.30 0.00 3.89 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 3.93 0.00 1.95 1.48 0.00 3.84 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 74 G 7.97 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.36 4.66 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 7.94 5.35 0.00 2.76 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 R 8.73 4.73 0.00 1.20 1.41 0.00 3.01 0.00 0.00 2.74 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.67 0.00 78 V 8.70 4.36 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 1.19 0.00 0.00 79 V 8.43 4.57 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.08 0.00 0.00 80 F 8.24 5.48 0.00 3.20 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 N 8.70 5.98 0.00 3.04 3.18 0.00 0.00 6.53 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 9.17 4.28 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 83 N 8.61 4.67 0.00 3.04 2.81 0.00 0.00 6.94 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 7.94 3.59 0.00 1.44 2.27 0.00 0.00 6.99 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 7.99 4.54 0.00 2.28 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.88 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 86 L 8.33 4.44 0.00 1.53 1.54 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.93 4.03 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 6.19 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.31 4.65 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 -0.28 0.00 0.00 90 I 8.24 4.99 1.76 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.40 0.41 0.00 0.00 91 T 8.88 5.28 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 92 H 9.28 4.64 0.00 3.23 3.22 0.00 5.69 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 7.75 4.11 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 94 G 9.21 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.67 4.85 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.57 4.33 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.15 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.65 4.52 0.00 2.68 2.75 0.00 0.00 6.79 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 N 7.90 4.87 0.00 2.97 2.81 0.00 0.00 6.80 8.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.79 5.41 0.00 3.28 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 9.00 5.04 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.15 0.00 0.00 102 E 8.79 4.23 0.00 1.74 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 103 C 8.73 4.82 0.00 3.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 T 8.25 4.14 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00